4-prop-2-enoxy-N,N-bis(prop-2-enyl)aniline

C15H19NO — CID 11817064

IUPAC4-prop-2-enoxy-N,N-bis(prop-2-enyl)aniline
SMILESC=CCOc1ccc(N(CC=C)CC=C)cc1
InChIInChI=1S/C15H19NO/c1-4-11-16(12-5-2)14-7-9-15(10-8-14)17-13-6-3/h4-10H,1-3,11-13H2
InChIKeyXKJNYVBLBQOJLM-UHFFFAOYSA-N
MW229.32 g/mol
LogP3.43
Rot. Bonds8

About 4-prop-2-enoxy-N,N-bis(prop-2-enyl)aniline

4-prop-2-enoxy-N,N-bis(prop-2-enyl)aniline (PubChem CID 11817064) has the molecular formula C15H19NO and a molecular weight of 229.32 g/mol. Its IUPAC name is 4-prop-2-enoxy-N,N-bis(prop-2-enyl)aniline.

Molecular Properties

Compound Name4-prop-2-enoxy-N,N-bis(prop-2-enyl)aniline
PubChem CID11817064
Molecular FormulaC15H19NO
Molecular Weight229.32 g/mol
Exact Mass229.15
IUPAC Name4-prop-2-enoxy-N,N-bis(prop-2-enyl)aniline
SMILESC=CCOc1ccc(N(CC=C)CC=C)cc1
InChIInChI=1S/C15H19NO/c1-4-11-16(12-5-2)14-7-9-15(10-8-14)17-13-6-3/h4-10H,1-3,11-13H2
InChIKeyXKJNYVBLBQOJLM-UHFFFAOYSA-N
XLogP3.43
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.32
LogP ≤ 53.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_C(246)', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

4-[bis(prop-2-enyl)amino]benzonitrile
CID 15882264
4-[4-[bis(prop-2-enyl)amino]phenyl]sulfanyl-N,N-bis(prop-2-enyl)aniline
CID 139763508
1-(bromomethoxy)-4-prop-2-enoxybenzene
CID 23452925
1,4-bis[2-(4-prop-2-enoxyphenyl)ethenyl]benzene
CID 89211050
4-phenyldiazenyl-N,N-bis(prop-2-enyl)aniline
CID 13007572
1-prop-2-enoxy-4-[(4-prop-2-enoxyphenyl)disulfanyl]benzene
CID 22556356
CID 174846151
CID 174846151
1-bromo-4-(4-prop-2-enoxyphenyl)benzene
CID 71426317
4-(4-prop-2-enoxyphenyl)phenol
CID 14817245
methyl 4-[bis(prop-2-enyl)amino]benzoate
CID 11806509
4-[3-[4-[bis(prop-2-enyl)amino]phenyl]pentan-3-yl]-N,N-bis(prop-2-enyl)aniline
CID 139763507
1-prop-2-enoxy-4-[1-(4-prop-2-enoxyphenyl)cyclopentyl]benzene
CID 23117522

Frequently Asked Questions

What is the IUPAC name of 4-prop-2-enoxy-N,N-bis(prop-2-enyl)aniline?
The IUPAC name of 4-prop-2-enoxy-N,N-bis(prop-2-enyl)aniline (CID 11817064) is 4-prop-2-enoxy-N,N-bis(prop-2-enyl)aniline.
What is the SMILES notation for 4-prop-2-enoxy-N,N-bis(prop-2-enyl)aniline?
The canonical SMILES for 4-prop-2-enoxy-N,N-bis(prop-2-enyl)aniline is C=CCOc1ccc(N(CC=C)CC=C)cc1.
What is the InChIKey of 4-prop-2-enoxy-N,N-bis(prop-2-enyl)aniline?
The InChIKey is XKJNYVBLBQOJLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19NO/c1-4-11-16(12-5-2)14-7-9-15(10-8-14)17-13-6-3/h4-10H,1-3,11-13H2.
What are the key properties of 4-prop-2-enoxy-N,N-bis(prop-2-enyl)aniline?
4-prop-2-enoxy-N,N-bis(prop-2-enyl)aniline has a molecular weight of 229.32 g/mol, XLogP of 3.43, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-prop-2-enoxy-N,N-bis(prop-2-enyl)aniline is sourced from PubChem (CID 11817064), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).